4-methyl-2-{[1-(2,4,5-trifluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}phenol
Chemical Structure Depiction of
4-methyl-2-{[1-(2,4,5-trifluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}phenol
4-methyl-2-{[1-(2,4,5-trifluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}phenol
Compound characteristics
| Compound ID: | V005-7610 |
| Compound Name: | 4-methyl-2-{[1-(2,4,5-trifluorophenyl)-4,5-dihydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl]methyl}phenol |
| Molecular Weight: | 386.42 |
| Molecular Formula: | C22 H21 F3 N2 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(c(CN2CCCn3cccc3C2c2cc(c(cc2F)F)F)c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9615 |
| logD: | 4.9588 |
| logSw: | -4.2566 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.4899 |
| InChI Key: | HIPSMMLXWSITPY-JOCHJYFZSA-N |